SCHEMBL14765145

SCHEMBL14765145

Cc1nc2ncccc2[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.53
ATAD2 Q6PL18 1/20 0.51
FGFR1 P11362 2/20 0.50
FLT1 P17948 2/20 0.50
PARP1 P09874 3/20 0.49
METAP1 P53582 2/20 0.47
METAP2 P50579 1/20 0.47
HPGD P15428 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
AURKA O14965 4/20 0.45
PDE5A O76074 3/20 0.44
DAO P14920 1/20 0.44
KMT2A Q03164 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL939186 0.79 NUDT1 (0.53) NUDT1ATAD2FGFR1FLT1PARP1
SCHEMBL1133963 0.79 NUDT1 (0.62) NUDT1ATAD2FGFR1FLT1PARP1
SCHEMBL3209670 0.79 NUDT1 (0.53) NUDT1ATAD2FGFR1FLT1PARP1
SCHEMBL805045 0.77 NUDT1 (0.60) NUDT1METAP1METAP2HPGDNPC1
SCHEMBL10375895 0.75 NUDT1 (0.49) NUDT1FGFR1FLT1PARP1METAP1
SCHEMBL8312963 0.74 NOS1 (0.44) PARP1DAOKMT2A
SCHEMBL323981 0.73 NUDT1 (0.60) NUDT1FGFR1FLT1METAP1METAP2
SCHEMBL10285823 0.73 MGAM (0.50) PARP1AURKA
SCHEMBL1170747 0.72 METAP1 (0.72) NUDT1FGFR1FLT1METAP1METAP2
SCHEMBL30617972 0.72 PLAUR (0.61) FGFR1HPGDNPC1RAB9ASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9056863-B2 Substituted 2,3,5,9,9B-pentaazacyclopenta[a]naphthalenes and uses thereof H. LUNDBECK A/S (DK) 2015-06-16 US disclosed
US-20140235645-A1 Pyridine Compounds and Uses Thereof H. LUNDBECK A/S (DK) 2014-08-21 US disclosed
EP-2763989-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. Lundbeck A/S (DK) 2014-08-13 EP disclosed
WO-2013034761-A1 PYRIDINE COMPOUNDS AND USES THEREOF H. LUNDBECK A/S (DK) 2013-03-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140235645-A1 Pyridine Compounds and Uses Thereof ATP6V1B2, NDUFS5, MT-ND5 NUDT1 279/4885ATAD2 2587/4885FGFR1 2400/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.